Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8950753 | 0.82 | HSD17B10 (0.43) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL736680 | 0.80 | HSD17B10 (0.61) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL12529998 | 0.80 | SMN1; SMN2 (0.37) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL21281618 | 0.79 | EIF4A3 (0.39) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL29290531 | 0.78 | ADRB1 (0.50) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL31500497 | 0.75 | TDP1 (0.38) | ALOX15ALOX12CYP1A2CYP2C19HIF1A | |
| SCHEMBL12529817 | 0.75 | LMNA (0.35) | SMN1; SMN2ALOX15ALOX12CYP1A2CYP2C9 | |
| SCHEMBL9334010 | 0.74 | UGT2B7 (0.46) | ALOX15HIF1AHSD17B10UGT2B7LMNA | |
| SCHEMBL9331671 | 0.74 | UGT2B7 (0.46) | ALOX15HIF1AHSD17B10UGT2B7LMNA | |
| SCHEMBL9331613 | 0.74 | UGT2B7 (0.46) | ALOX15HIF1AHSD17B10UGT2B7LMNA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007102127-A2 | NEW AMINES | ACTELION PHARMACEUTICALS LTD (CH) | 2007-09-13 | — | — | WO | disclosed |
| WO-2007099509-A2 | PRIMARY AMINES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2007-09-07 | — | — | WO | disclosed |